Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.39 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.38 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.38 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.38 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | P2RX7 | Q99572 | 4/20 | 0.37 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.37 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.37 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | CFTR | P13569 | 1/20 | 0.36 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL22203190 | 1.00 | ALDH1A1 (0.41) | ALDH1A1HPGDLMNAHTTHSD17B10 | |
| SCHEMBL28662755 | 0.90 | ALDH1A1 (0.39) | ALDH1A1HPGDLMNAHTTHSD17B10 | |
| SCHEMBL28655627 | 0.88 | PLA2G2A (0.45) | ALDH1A1HPGDLMNAHTTHSD17B10 | |
| SCHEMBL22203189 | 0.87 | NOTUM (0.41) | NOTUMP2RX7SCN9A | |
| SCHEMBL28668984 | 0.84 | TP53 (0.38) | ALDH1A1HPGDLMNAHTTHSD17B10 | |
| SCHEMBL30065779 | 0.84 | TP53 (0.38) | ALDH1A1HPGDLMNAHTTHSD17B10 | |
| SCHEMBL28650263 | 0.82 | PLA2G2A (0.39) | ALDH1A1HPGDLMNAHTTHSD17B10 | |
| SCHEMBL23099926 | 0.80 | CFTR (0.51) | MRGPRX4PPARGCFTR | |
| SCHEMBL30065560 | 0.79 | SORT1 (0.48) | LMNAEPHX2MAPT | |
| SCHEMBL23727489 | 0.79 | CFTR (0.44) | ALDH1A1LMNAHTTMRGPRX4NOTUM |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112955436-B | 6-oxo-1, 6-dihydropyridazine derivatives, preparation method and application thereof in medicines | 福建盛迪医药有限公司 | 2023-08-11 | — | — | CN | disclosed |
| CN-112996774-B | 2-oxo-1,2-dihydropyridine derivative, preparation method and application thereof in medicine | 江苏恒瑞医药股份有限公司 | 2022-11-22 | — | — | CN | disclosed |